5-[(3-methoxycyclobutyl)amino]-1-methylpiperidin-2-one

C11H20N2O2 — CID 104871603

IUPAC5-[(3-methoxycyclobutyl)amino]-1-methylpiperidin-2-one
SMILESCOC1CC(NC2CCC(=O)N(C)C2)C1
InChIInChI=1S/C11H20N2O2/c1-13-7-8(3-4-11(13)14)12-9-5-10(6-9)15-2/h8-10,12H,3-7H2,1-2H3
InChIKeyQIUVHJVBSGYHMI-UHFFFAOYSA-N
MW212.29 g/mol
LogP0.37
Rot. Bonds3

About 5-[(3-methoxycyclobutyl)amino]-1-methylpiperidin-2-one

5-[(3-methoxycyclobutyl)amino]-1-methylpiperidin-2-one (PubChem CID 104871603) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is 5-[(3-methoxycyclobutyl)amino]-1-methylpiperidin-2-one.

Molecular Properties

Compound Name5-[(3-methoxycyclobutyl)amino]-1-methylpiperidin-2-one
PubChem CID104871603
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name5-[(3-methoxycyclobutyl)amino]-1-methylpiperidin-2-one
SMILESCOC1CC(NC2CCC(=O)N(C)C2)C1
InChIInChI=1S/C11H20N2O2/c1-13-7-8(3-4-11(13)14)12-9-5-10(6-9)15-2/h8-10,12H,3-7H2,1-2H3
InChIKeyQIUVHJVBSGYHMI-UHFFFAOYSA-N
XLogP0.37
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-[(3-methoxycyclobutyl)amino]-1-methylpiperidin-2-one?
The IUPAC name of 5-[(3-methoxycyclobutyl)amino]-1-methylpiperidin-2-one (CID 104871603) is 5-[(3-methoxycyclobutyl)amino]-1-methylpiperidin-2-one.
What is the SMILES notation for 5-[(3-methoxycyclobutyl)amino]-1-methylpiperidin-2-one?
The canonical SMILES for 5-[(3-methoxycyclobutyl)amino]-1-methylpiperidin-2-one is COC1CC(NC2CCC(=O)N(C)C2)C1.
What is the InChIKey of 5-[(3-methoxycyclobutyl)amino]-1-methylpiperidin-2-one?
The InChIKey is QIUVHJVBSGYHMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-13-7-8(3-4-11(13)14)12-9-5-10(6-9)15-2/h8-10,12H,3-7H2,1-2H3.
What are the key properties of 5-[(3-methoxycyclobutyl)amino]-1-methylpiperidin-2-one?
5-[(3-methoxycyclobutyl)amino]-1-methylpiperidin-2-one has a molecular weight of 212.29 g/mol, XLogP of 0.37, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3-methoxycyclobutyl)amino]-1-methylpiperidin-2-one is sourced from PubChem (CID 104871603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).